N-[(2-methyl-3-nitro-phenyl)carbamothioyl]-3-phenethyloxy-benzamide

Systemtic Name: N-[(2-methyl-3-nitro-phenyl)carbamothioyl]-3-phenethyloxy-benzamide Openeye Name: N-[(2-methyl-3-nitro-phenyl)carbamothioyl]-3-phenethyloxy-benzamide CAS Name: N-[(2-methyl-3-nitroanilino)-sulfanylidenemethyl]-3-phenethyloxybenzamide IUPAC Name: N-[(2-methyl-3-nitrophenyl)carbamothioyl]-3-phenethyloxybenzamide Traditional Name: N-[(2-methyl-3-nitro-phenyl)thiocarbamoyl]-3-phenethyloxy-benzamide Formula: C23H21N3O4S MolecularWeight: 435.49554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C23H21N3O4S/c1-16-20(11-6-12-21(16)26(28)29)24-23(31)25-22(27)18-9-5-10-19(15-18)30-14-13-17-7-3-2-4-8-17/h2-12,15H,13-14H2,1H3,(H2,24,25,27,31)